BDBM78700 2-(2-{4-[3-(2-allylphenoxy)-2-hydroxypropyl]-1-piperazinyl}ethyl)-1H-benzo[de]isoquinoline-1,3(2H)-dione dihydrochloride::2-[2-[4-[2-hydroxy-3-(2-prop-2-enylphenoxy)propyl]-1-piperazinyl]ethyl]benzo[de]isoquinoline-1,3-dione;hydrochloride::2-[2-[4-[2-hydroxy-3-(2-prop-2-enylphenoxy)propyl]piperazin-1-yl]ethyl]benzo[de]isoquinoline-1,3-dione;hydrochloride::2-[2-[4-[2-oxidanyl-3-(2-prop-2-enylphenoxy)propyl]piperazin-1-yl]ethyl]benzo[de]isoquinoline-1,3-dione;hydrochloride::2-[2-[4-[3-(2-allylphenoxy)-2-hydroxy-propyl]piperazino]ethyl]benzo[de]isoquinoline-1,3-quinone;hydrochloride::CHEMBL1083672::MLS000680564::SMR000268752::cid_15945836

SMILES: OC(COc1ccccc1CC=C)CN1CCN(CCN2C(=O)c3cccc4cccc(C2=O)c34)CC1

InChI Key: InChIKey=YRMGKUZRKWDWIE-UHFFFAOYSA-N

Data: 3 KI  3 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 6 hits for monomerid = 78700   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Ubiquitin-conjugating enzyme E2 N (Human)	BDBM78700 (2-[2-[4-[2-hydroxy-3-(2-prop-2-enylphenoxy)propyl]...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.72E+4	n/a	n/a	n/a	n/a	n/a	n/a
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Ubiquitin-conjugating enzyme E2 N (Human)	BDBM78700 (2-[2-[4-[2-hydroxy-3-(2-prop-2-enylphenoxy)propyl]...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.77E+4	n/a	n/a	n/a	n/a	n/a	n/a
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Bcl-2-related protein A1 (Mouse)	BDBM78700 (2-[2-[4-[2-hydroxy-3-(2-prop-2-enylphenoxy)propyl]...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>2.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
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Beta-2 adrenergic receptor (Human)	BDBM78700 (2-[2-[4-[2-hydroxy-3-(2-prop-2-enylphenoxy)propyl]...) Show SMILES Show InChI	GoogleScholar	UniChem		150	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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Beta-1 adrenergic receptor (Human)	BDBM78700 (2-[2-[4-[2-hydroxy-3-(2-prop-2-enylphenoxy)propyl]...) Show SMILES Show InChI	GoogleScholar	UniChem		293	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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Beta-3 adrenergic receptor (Human)	BDBM78700 (2-[2-[4-[2-hydroxy-3-(2-prop-2-enylphenoxy)propyl]...) Show SMILES Show InChI	GoogleScholar	UniChem		3.10E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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